2733-3751 Screening compound: (2Z)-2-[(3-bromo-4-methoxyphenyl)formamido]-N-(4-methylphenyl)-3-(3-nitrophenyl)prop-2-enamide

2733-3751 Screening compound: (2Z)-2-[(3-bromo-4-methoxyphenyl)formamido]-N-(4-methylphenyl)-3-(3-nitrophenyl)prop-2-enamide
2733-3751 Screening compound: (2Z)-2-[(3-bromo-4-methoxyphenyl)formamido]-N-(4-methylphenyl)-3-(3-nitrophenyl)prop-2-enamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 2733-3751
(2Z)-2-[(3-bromo-4-methoxyphenyl)formamido]-N-(4-methylphenyl)-3-(3-nitrophenyl)prop-2-enamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

2733-3751

Molecular Formula

C24H20BrN3O5 (C24 H20 BrN3 O5)

Compound Name

(2Z)-2-[(3-bromo-4-methoxyphenyl)formamido]-N-(4-methylphenyl)-3-(3-nitrophenyl)prop-2-enamide

IUPAC name

(2Z)-2-[(3-bromo-4-methoxyphenyl)formamido]-N-(4-methylphenyl)-3-(3-nitrophenyl)prop-2-enamide

SMILES

Cc(cc1)ccc1NC(/C(/NC(c(cc1)cc(Br)c1OC)=O)=C/c1cc([N+]([O-])=O)ccc1)=O

InChI

InChI=1S/C24H20BrN3O5/c1-15-6-9-18(10-7-15)26-24(30)21(13-16-4-3-5-19(12-16)28(31)32)27-23(29)17-8-11-22(33-2)20(25)14-17/h3-14H,1-2H3,(H,26,30)(H,27,29)

InChI Key

QJRJGHATRPLPBH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01932770

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

510.34

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.145

Distribution Coefficient, logD

4.709

Water Solubility, LogSw

-5.09

Polar Surface Area

86.266

Acid Dissociation Constant (pKa)

7.16

Base Dissociation Constant (pKb)

3.23

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

2733-3751 in Drug Discovery

Included in Screening Libraries

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 2733-3751 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2733-3751?
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What is the minimum amount of 2733-3751 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2733-3751
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2733-3751
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 2733-3751 available by request